3-cyano-5-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid

Systemtic Name: 3-cyano-5-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid Openeye Name: 3-[2-[2-benzyloxy-5-(trifluoromethyl)phenyl]phenyl]-5-cyano-benzoic acid CAS Name: 3-cyano-5-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid IUPAC Name: 3-cyano-5-[2-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]phenyl]benzoic acid Traditional Name: 3-[2-[2-benzoxy-5-(trifluoromethyl)phenyl]phenyl]-5-cyano-benzoic acid Formula: C28H18F3NO3 MolecularWeight: 473.44263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(F)(F)F)C3=CC=CC=C3C4=CC(=CC(=C4)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(F)(F)F)C3=CC=CC=C3C4=CC(=CC(=C4)C#N)C(=O)O

InChI

InChI=1S/C28H18F3NO3/c29-28(30,31)22-10-11-26(35-17-18-6-2-1-3-7-18)25(15-22)24-9-5-4-8-23(24)20-12-19(16-32)13-21(14-20)27(33)34/h1-15H,17H2,(H,33,34)